3-(1,1-Dioxido-1,3-dithian-2-yl)pyridine
TL;DR: 3-(1,1-Dioxido-1,3-dithian-2-yl)pyridine (CAS 126864-61-7) is a chemical compound with molecular formula C9H11NO2S2 and molecular weight 229.02312 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-pyridin-3-yl-1,3-dithiane 1,1-dioxide
Also Known As: 2-pyridin-3-yl-1,3-dithiane 1,1-dioxide, 3-(1,1-dioxido-1,3-dithian-2-yl)pyridine, 3-(1,3-dithian-2-yl)pyridine 1,1-dioxide, 2-(pyridin-3-yl)-1,3-dithiane 1,1-dioxide
Technical Specifications
| Molecular Formula | C9H11NO2S2 |
| Molecular Weight | 229.02312 g/mol |
| XLogP | 0.9 |
| Topological Polar Surface Area (TPSA) | 80.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 229.02312 Da |
| Heavy Atoms | 14 |
| Complexity | 284.0 |
| SMILES | C1CSC(S(=O)(=O)C1)C2=CN=CC=C2 |
| InChIKey | WESSSVJXQYMSOO-UHFFFAOYSA-N |
Chemical Property Profile of 3-(1,1-Dioxido-1,3-dithian-2-yl)pyridine
Property Insights of 3-(1,1-Dioxido-1,3-dithian-2-yl)pyridine
The XLogP value of 0.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-(1,1-Dioxido-1,3-dithian-2-yl)pyridine. The TPSA of 80.7 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-(1,1-Dioxido-1,3-dithian-2-yl)pyridine. Following Lipinski's Rule of Five, 3-(1,1-Dioxido-1,3-dithian-2-yl)pyridine has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 3-(1,1-Dioxido-1,3-dithian-2-yl)pyridine?
The CAS number of 3-(1,1-Dioxido-1,3-dithian-2-yl)pyridine is 126864-61-7.
What is the molecular formula of 3-(1,1-Dioxido-1,3-dithian-2-yl)pyridine?
The molecular formula of 3-(1,1-Dioxido-1,3-dithian-2-yl)pyridine is C9H11NO2S2.
What is the molecular weight of 3-(1,1-Dioxido-1,3-dithian-2-yl)pyridine?
The molecular weight of 3-(1,1-Dioxido-1,3-dithian-2-yl)pyridine is 229.02312 g/mol.
Where can I buy 3-(1,1-Dioxido-1,3-dithian-2-yl)pyridine?
You can request a quote for 3-(1,1-Dioxido-1,3-dithian-2-yl)pyridine directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 3-(1,1-Dioxido-1,3-dithian-2-yl)pyridine?
Yes, CoreyChem provides custom synthesis services for 3-(1,1-Dioxido-1,3-dithian-2-yl)pyridine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.